1,3-bis(hydroxymethyl)imidazolidin-2-one

C5H10N2O3 — CID 8704

IUPAC1,3-bis(hydroxymethyl)imidazolidin-2-one
SMILESO=C1N(CO)CCN1CO
InChIInChI=1S/C5H10N2O3/c8-3-6-1-2-7(4-9)5(6)10/h8-9H,1-4H2
InChIKeyWVJOGYWFVNTSAU-UHFFFAOYSA-N
MW146.15 g/mol
LogP-1.38
Rot. Bonds2

About 1,3-bis(hydroxymethyl)imidazolidin-2-one

1,3-bis(hydroxymethyl)imidazolidin-2-one (PubChem CID 8704) has the molecular formula C5H10N2O3 and a molecular weight of 146.15 g/mol. Its IUPAC name is 1,3-bis(hydroxymethyl)imidazolidin-2-one.

Molecular Properties

Compound Name1,3-bis(hydroxymethyl)imidazolidin-2-one
PubChem CID8704
Molecular FormulaC5H10N2O3
Molecular Weight146.15 g/mol
Exact Mass146.07
IUPAC Name1,3-bis(hydroxymethyl)imidazolidin-2-one
SMILESO=C1N(CO)CCN1CO
InChIInChI=1S/C5H10N2O3/c8-3-6-1-2-7(4-9)5(6)10/h8-9H,1-4H2
InChIKeyWVJOGYWFVNTSAU-UHFFFAOYSA-N
XLogP-1.38
TPSA64.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.15
LogP ≤ 5-1.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,3-bis(hydroxymethyl)imidazolidin-2-one?
The IUPAC name of 1,3-bis(hydroxymethyl)imidazolidin-2-one (CID 8704) is 1,3-bis(hydroxymethyl)imidazolidin-2-one.
What is the SMILES notation for 1,3-bis(hydroxymethyl)imidazolidin-2-one?
The canonical SMILES for 1,3-bis(hydroxymethyl)imidazolidin-2-one is O=C1N(CO)CCN1CO.
What is the InChIKey of 1,3-bis(hydroxymethyl)imidazolidin-2-one?
The InChIKey is WVJOGYWFVNTSAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O3/c8-3-6-1-2-7(4-9)5(6)10/h8-9H,1-4H2.
What are the key properties of 1,3-bis(hydroxymethyl)imidazolidin-2-one?
1,3-bis(hydroxymethyl)imidazolidin-2-one has a molecular weight of 146.15 g/mol, XLogP of -1.38, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-bis(hydroxymethyl)imidazolidin-2-one is sourced from PubChem (CID 8704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).